N-cyclopropyl-N-[[3-(2-piperidin-1-ium-1-ylethoxy)phenyl]methyl]pyridine-4-carboxamide

Systemtic Name: N-cyclopropyl-N-[[3-(2-piperidin-1-ium-1-ylethoxy)phenyl]methyl]pyridine-4-carboxamide Openeye Name: N-cyclopropyl-N-[[3-(2-piperidin-1-ium-1-ylethoxy)phenyl]methyl]pyridine-4-carboxamide CAS Name: N-cyclopropyl-N-[[3-[2-(1-piperidin-1-iumyl)ethoxy]phenyl]methyl]-4-pyridinecarboxamide IUPAC Name: N-cyclopropyl-N-[[3-(2-piperidin-1-ium-1-ylethoxy)phenyl]methyl]pyridine-4-carboxamide Traditional Name: N-cyclopropyl-N-[3-(2-piperidin-1-ium-1-ylethoxy)benzyl]isonicotinamide Formula: C23H30N3O2+ MolecularWeight: 380.5032

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CCOC2=CC=CC(=C2)CN(C3CC3)C(=O)C4=CC=NC=C4

Isomeric SMILES

C1CC[NH+](CC1)CCOC2=CC=CC(=C2)CN(C3CC3)C(=O)C4=CC=NC=C4

InChI

InChI=1S/C23H29N3O2/c27-23(20-9-11-24-12-10-20)26(21-7-8-21)18-19-5-4-6-22(17-19)28-16-15-25-13-2-1-3-14-25/h4-6,9-12,17,21H,1-3,7-8,13-16,18H2/p+1